[3-(2-Amino-3-nitro-phenylcarbamoyl)-propyl]methyl-carbamic acid tert-butyl ester

HCID 68412474
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Basic information

Standard SMILES
CN(CCCC(=O)Nc1cccc([N+](=O)[O-])c1N)C(=O)OC(C)(C)C
InChIKey
UHEXYNGWXCHYJI-UHFFFAOYSA-N
Molecular formula
C16H24N4O5
Average molar mass
352.39 g/mol

Names & identifiers

Preferred name
[3-(2-Amino-3-nitro-phenylcarbamoyl)-propyl]methyl-carbamic acid tert-butyl ester
IUPAC
tert-butyl N-[4-(2-amino-3-nitroanilino)-4-oxobutyl]-N-methylcarbamate

Names & synonyms

SCHEMBL2842452UHEXYNGWXCHYJI-UHFFFAOYSA-N[3-(2-Amino-3-nitro-phenylcarbamoyl)-propyl]methyl-carbamic acid tert-butyl ester

Database identifiers

PubChem CID
68412474

Properties

Computed structural properties

XLogP
2
Topological polar surface area
130 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
25

Related reactions

3 records
New reaction record

Compound notes

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